SCHEMBL10784353

SCHEMBL10784353

CCCCCCCCC(CCCCCCCC)(CCCCCCCC)C(=O)OC(=O)CC(O)(CC(=O)OC(=O)C(CCCCCCCC)(CCCCCCCC)CCCCCCCC)C(=O)OC(=O)C(CCCCCCCC)(CCCCCCCC)CCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NAAA Q02083 1/20 0.37
SMPD1 P17405 1/20 0.37
FDPS P14324 8/20 0.36
GGPS1 O95749 6/20 0.36
CES2 O00748 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
DGKA P23743 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL140635 0.93 NAAA (0.32) MEN1MAPTKMT2AATML3MBTL1
SCHEMBL317820 0.85 ALDH1A1 (0.43) MEN1KMT2ANAAALMNA
SCHEMBL819441 0.85 ALDH1A1 (0.43) MEN1KMT2ANAAALMNA
SCHEMBL28886961 0.82 CES2 (0.44) MEN1MAPTKMT2AATML3MBTL1
SCHEMBL7091541 0.80 DGKA (0.47) MAPTNAAACES2LMNADGKA
SCHEMBL29395184 0.80 DGKA (0.47) MAPTNAAACES2LMNADGKA
SCHEMBL201428 0.80 DGKA (0.50) MEN1MAPTKMT2ANAAACES2
SCHEMBL774575 0.79 CYP4F2 (0.31)
SCHEMBL42853 0.78 ALDH1A1 (0.46) MEN1MAPTKMT2AL3MBTL1LMNA
SCHEMBL11115359 0.78 DGKA (0.44) MAPTNAAACES2LMNADGKA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0095526-B1 MEDICAL CONTAINERS TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1987-08-19 EP disclosed
US-4687474-A ADHESION OF VINYL CHLORIDE POLYMER PASTE, RESIN AND PLASTICIZER; TRANSFUSION BAG TERUMO KABUSHIKI KAISHA (JP) 1987-08-18 US disclosed
US-4655764-A Medical needle assembly and medical device incorporating the same TERUMO CORPORATION (JP) 1987-04-07 US disclosed
US-4507123-A Medical containers TERUMO KABUSHIKI KAISHA (JP) 1985-03-26 US disclosed
EP-0095526-A2 Medical containers TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1983-12-07 EP disclosed